write_thermdat output to console vs file

VlachosGroup / pMuTT

Python Multiscale Thermochemistry Toolbox (pMuTT)

https://vlachosgroup.github.io/pMuTT/

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Closed wittregr closed 4 years ago

wittregr commented 4 years ago

write_thermdat requires output to a file. Add an option to output to screen/console instead of file

jonlym commented 4 years ago

If filename is not specified to write_thermdat, the file will be returned as a string that can be printed to console.